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PreprintLicence not statedChemRxiv

Adaptive Hydration-Shell ML/MM Simulations Recover Full ML Accuracy in Biomolecular Conformational Description

  • Harshvardhan Pande1,2,3
  • Qiang Zhu1,2,3
  • Haibo Yu1,2,3
  1. 1School of Science and Molecular Horizons
  2. 2University of Wollongong
  3. 3ARC Centre of Excellence in Quantum Biotechnology
Open at sourceDOICite

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Cite

BibTeXRIS
BibTeX
@misc{pande2026adaptive,
  title = {{Adaptive Hydration-Shell ML/MM Simulations Recover Full ML Accuracy in Biomolecular Conformational Description}},
  author = {Harshvardhan Pande and Qiang Zhu and Haibo Yu},
  howpublished = {ChemRxiv},
  year = {2026},
  month = oct,
  doi = {10.26434/chemrxiv.15011271/v1},
  url = {https://chemrxiv.org/doi/full/10.26434/chemrxiv.15011271/v1},
}
RIS
TY  - UNPB
TI  - Adaptive Hydration-Shell ML/MM Simulations Recover Full ML Accuracy in Biomolecular Conformational Description
AU  - Harshvardhan Pande
AU  - Qiang Zhu
AU  - Haibo Yu
PY  - 2026
DA  - 2026/10/29
PB  - ChemRxiv
DO  - 10.26434/chemrxiv.15011271/v1
UR  - https://chemrxiv.org/doi/full/10.26434/chemrxiv.15011271/v1
ER  -